4-(azepan-1-yl)-N-[1-(2,3-dimethylpentyl)piperidin-3-yl]pyrimidin-2-amine

Systemtic Name: 4-(azepan-1-yl)-N-[1-(2,3-dimethylpentyl)piperidin-3-yl]pyrimidin-2-amine Openeye Name: 4-(azepan-1-yl)-N-[1-(2,3-dimethylpentyl)-3-piperidyl]pyrimidin-2-amine CAS Name: 4-(1-azepanyl)-N-[1-(2,3-dimethylpentyl)-3-piperidinyl]-2-pyrimidinamine IUPAC Name: 4-(azepan-1-yl)-N-[1-(2,3-dimethylpentyl)piperidin-3-yl]pyrimidin-2-amine Traditional Name: [4-(azepan-1-yl)pyrimidin-2-yl]-[1-(2,3-dimethylpentyl)-3-piperidyl]amine Formula: C22H39N5 MolecularWeight: 373.57856

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C)CN1CCCC(C1)NC2=NC=CC(=N2)N3CCCCCC3

Isomeric SMILES

CCC(C)C(C)CN1CCCC(C1)NC2=NC=CC(=N2)N3CCCCCC3

InChI

InChI=1S/C22H39N5/c1-4-18(2)19(3)16-26-13-9-10-20(17-26)24-22-23-12-11-21(25-22)27-14-7-5-6-8-15-27/h11-12,18-20H,4-10,13-17H2,1-3H3,(H,23,24,25)